Vitas-M small molecule compound
3-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-4-[(7-methoxy-1-benzofuran-2-yl)carbonyl]-5-(4-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK818109
SMILES COc1cccc2c1oc(c2)C(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])CCCn1cncc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C26H22N4O7 MW 502.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N4O7/c1-36-19-5-2-4-17-14-20(37-25(17)19)23(31)21-22(16-6-8-18(9-7-16)30(34)35)29(26(33)24(21)32)12-3-11-28-13-10-27-15-28/h2,4-10,13-15,22,32H,3,11-12H2,1H3InChIKey
YZQDOIIPKFKANR-UHFFFAOYSA-NSynonyms
3hydroxy1(3(1Himidazol1yl)propyl)4((7methoxy1benzofuran2yl)carbonyl)5(4nitrophenyl)15dihydro2Hpyrrol2one
4HYDROXY1(3IMIDAZOL1YLPROPYL)3(7METHOXY1BENZOFURAN2CARBONYL)2(4NITROPHENYL)2HPYRROL5ONE
COC1=CC=CC2=C1OC(=C2)C(=O)C3=C(C(=O)N(C3C4=CC=C(C=C4)(N+)(=O)(O))CCCN5C=CN=C5)O
COc1cccc2c1oc(c2)C(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)(N+)(=O)(O))CCCn1cncc1
InChI=1SC26H22N4O7c13619524171420(3725(17)19)23(31)2122(166818(9716)30(34)35)29(26(33)24(21)32)12311281310271528h241013152232H31112H21H3
MFCD04217113
ZINC000001109141
ZINC000001109142
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